2RFC

ligand bound (4-phenylimidazole) crystal structure of a cytochrome p450 from the thermoacidophilic archaeon picrophilus torridus

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 66
  • Norm. En. per Res.: -3.1712
• Hub Node: A(2)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-30.3576	-32.8035	-146.136	-209.2971	66	19	0	6492	4	46	50
A-C	-22.2412	-4.5671	-124.808	-151.6163	91	16	0	6870	0	38	36
B-C	-4.7638	-7.9863	-9.8852	-22.6354	34	0	0	737	0	28	16
B-D	-41.2539	-39.2398	-164.265	-244.7587	90	23	0	7794	3	35	40
C-D	0.0	-4.9239	-5.938	-10.8619	26	0	0	562	0	15	11

Interface residues

• A-B: ALA250B, ARG110A, ARG336A, ASN100A, ASN145A, ASN256B, ASN257B, ASN36B, ASN61B, ASN97A, ASP102A, ASP143A, ASP14B, ASP252B, ASP29B, ASP331A, ASP339A, ASP347A, ASP37B, ASP99A, GLU106A, GLU251B, GLY300B, HIS32B, ILE103A, ILE255B, ILE260B, ILE299B, ILE301B, ILE39B, ILE98A, LEU132A, LEU349A, LEU34B, LEU351A, LYS101A, LYS131A, LYS141A, LYS258B, LYS259B, LYS262B, LYS26B, LYS31B, LYS333A, LYS334A, LYS348A, LYS38B, MET293B, MET35B, PHE279B, PHE350A, PHE40B, PRO128A, PRO15B, PRO62B, SER105A, SER253B, SER28B, SER335A, SER352A, TYR254B, TYR27B, TYR332A, VAL24B, VAL30B, VAL33B
• A-C: ALA173A, ALA223C, ALA307C, ARG152A, ARG156A, ARG227C, ARG290C, ARG291C, ARG311C, ARG47A, ARG68C, ASN145A, ASN147A, ASN150A, ASN151A, ASN226C, ASN319C, ASN323C, ASN81C, ASP126A, ASP185A, ASP222C, ASP320C, ASP82C, ASP85C, CYS304C, GLU144A, GLU159A, GLU186A, GLU232C, GLU233C, GLU292C, GLU88C, GLY229C, GLY289C, GLY300C, HIS294C, ILE160A, ILE188A, ILE288C, ILE299C, ILE316C, ILE80C, ILE87C, LEU129A, LEU132A, LEU157A, LEU158A, LEU182A, LEU224C, LEU312C, LEU318C, LEU76C, LYS131A, LYS141A, LYS162A, LYS181A, LYS187A, LYS189A, LYS225C, LYS287C, LYS31C, LYS79C, LYS84C, MET153A, MET184A, MET192A, MET293C, MET303C, MET35C, PHE161A, PHE230C, PHE279C, PHE297C, PRO123A, PRO128A, PRO308C, PRO73C, PRO77C, SER125A, SER155A, SER163A, SER228C, SER315C, SER78C, THR183A, THR234C, TYR148A, TYR83C, VAL154A, VAL231C
• B-C: ALA223C, ALA250B, ARG180B, ARG291C, ARG47B, ASN179B, ASN46B, ASP185B, ASP218C, ASP221C, ASP222C, ASP276C, ASP281C, ASP60B, GLU186B, GLU277C, GLU282C, GLU63B, GLY289C, ILE219C, ILE220C, ILE288C, LEU285C, LYS178B, LYS181B, LYS225C, LYS262B, LYS287C, LYS38B, PHE279C, PHE286C, PRO62B, THR183B, THR278C
• B-D: ALA223D, ALA296D, ALA307D, ARG110B, ARG152B, ARG156B, ARG227D, ARG236D, ARG290D, ARG291D, ARG311D, ARG68D, ASN145B, ASN147B, ASN150B, ASN151B, ASN226D, ASN319D, ASN81D, ASP126B, ASP143B, ASP185B, ASP222D, ASP82D, ASP85D, GLU144B, GLU159B, GLU232D, GLU233D, GLU292D, GLU88D, GLY229D, GLY289D, GLY298D, GLY300D, HIS294D, ILE160B, ILE188B, ILE288D, ILE299D, ILE301D, ILE316D, ILE80D, LEU129B, LEU132B, LEU157B, LEU158B, LEU224D, LEU235D, LEU295D, LEU312D, LEU318D, LEU76D, LYS131B, LYS141B, LYS162B, LYS225D, LYS287D, LYS31D, LYS79D, LYS84D, MET127B, MET153B, MET184B, MET293D, MET303D, MET35D, PHE146B, PHE230D, PHE279D, PHE280D, PHE297D, PHE75D, PRO123B, PRO128B, PRO308D, PRO77D, SER125B, SER155B, SER163B, SER228D, SER315D, SER78D, THR183B, TYR136B, TYR148B, TYR27D, VAL149B, VAL154B, VAL231D
• C-D: ARG180D, ASN13C, ASN179D, ASP164D, ASP19C, ASP284C, GLU282C, GLY174D, HIS17C, HIS23C, LEU12C, LEU177D, LEU285C, LEU337C, LYS178D, LYS181D, LYS258C, LYS341C, LYS79D, PRO15C, SER175D, SER176D, TRP22C, TYR18C, TYR25C, VAL16C